SCHEMBL7399486

SCHEMBL7399486

CC(C(N)=O)N(C)Cc1ccc(NCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
FFAR1 O14842 6/20 0.52
FFAR4 Q5NUL3 2/20 0.52
HIF1A Q16665 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
HTT P42858 1/20 0.45
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9131086 1.00 MEN1 (0.56) MEN1KMT2AFFAR1FFAR4HIF1A
SCHEMBL19182844 0.86 KMT2A (0.55) MEN1KMT2ACA12CA9ALDH1A1
SCHEMBL17372647 0.86 KMT2A (0.55) MEN1KMT2ACA12CA9ALDH1A1
Hydrochloric Acid SCHEMBL6529136 0.84 KMT2A (0.54) MEN1KMT2ACA12CA9ALDH1A1
SCHEMBL7398789 0.83 MEN1 (0.53) MEN1KMT2ACA12CA9ALDH1A1
SCHEMBL7398546 0.83 MEN1 (0.53) MEN1KMT2ACA12CA9ALDH1A1
SCHEMBL7390817 0.78 FFAR1 (0.54) FFAR1FFAR4HIF1ACA1CA2
SCHEMBL7390821 0.78 FFAR1 (0.54) FFAR1FFAR4HIF1ACA1CA2
SCHEMBL9127455 0.76 SLC6A4 (0.52) MEN1KMT2AFFAR1ALDH1A1
SCHEMBL7394066 0.76 SLC6A4 (0.52) MEN1KMT2AFFAR1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0400495-B1 N-phenylalkyl substituted alpha-amino carboxamide derivatives and process for their preparation. ERBA CARLO SPA (IT) 1993-11-03 EP disclosed
EP-0426816-A1 N-PHENYLALKYL SUBSTITUTED $g(a)-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-05-15 EP disclosed
EP-0400495-A1 N-phenylalkyl substituted alfa-amino carboxamide derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1990-12-05 EP disclosed
WO-1990014334-A1 N-PHENYLALKYL SUBSTITUTED α-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1990-11-29 WO disclosed